Information card for entry 2205559

Structure parameters

• Chemical name: cis-dichlorobis(phenanthroline-κ^2^N,N')manganese(II)
• Formula: C24 H16 Cl2 Mn N4
• Calculated formula: C24 H16 Cl2 Mn N4
• SMILES: [Mn]12(Cl)(Cl)([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13
• Title of publication: A polymorph of <i>cis</i>-dichlorobis(phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)
• Authors of publication: Tian-Tian Pan; Duan-Jun Xu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: m740 - m742
• a: 10.1597 ± 0.0018 Å
• b: 17.105 ± 0.002 Å
• c: 12.593 ± 0.002 Å
• α: 90°
• β: 100.178 ± 0.004°
• γ: 90°
• Cell volume: 2154 ± 0.6 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for significantly intense reflections: 0.199
• Weighted residual factors for all reflections included in the refinement: 0.221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes